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[8,3',5'-D3]-Formononetin {7-hydroxy-3-(4-methoxyphenyl-3,5-D2)-4H-1-benzopyran-4-one-8-D}
SpectraBase Compound ID AsEV2y9vf3f
InChI InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3/i5D,6D,8D
InChIKey HKQYGTCOTHHOMP-QRHWFVISSA-N
Mol Weight 271.29 g/mol
Molecular Formula C16H9D3O4
Exact Mass 271.092389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5ItB5KdWmI
Name [8,3',5'-D3]-Formononetin {7-hydroxy-3-(4-methoxyphenyl-3,5-D2)-4H-1-benzopyran-4-one-8-D}
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9D3O4
InChI InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3/i5D,6D,8D
InChIKey HKQYGTCOTHHOMP-QRHWFVISSA-N
Molecular Weight 271.286 g/mol
SMILES Oc1c(c2OC=C(C(c2cc1)=O)c1cc([D])c(c(c1)[D])OC)[D]
SPLASH splash10-00di-0290000000-655dfc67818d77d88666
Source of Spectrum F-55-3451-4
Synonyms 8-Deuterio-3-(3,5-dideuterio-4-methoxyphenyl)-7-hydroxy-1-benzopyran-4-one 8-Deuterio-3-(3,5-dideuterio-4-methoxyphenyl)-7-hydroxychromen-4-one 8-Deuterio-3-(3,5-dideuterio-4-methoxy-phenyl)-7-hydroxy-chromen-4-one 8-Deuterio-3-(3,5-dideuterio-4-methoxy-phenyl)-7-oxidanyl-chromen-4-one
Wiley ID 837384